%chk=000053346.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053346

0 1
 N  -0.5533000     -9.0000004E-02   1.433800    
 N    3.085200      7.1199998E-02 -0.6409000    
 N   -3.808300     -4.1499998E-02  -2.174500    
 C   0.6805000     -3.5200000E-02  0.7302000    
 C    1.253100       1.205000      0.4302000    
 C    1.311400      -1.222100      0.3441000    
 C    2.473200       1.211500     -0.2666000    
 C    2.529300      -1.120700     -0.3493000    
 C   -1.885700     -0.1076000       1.001000    
 C   0.6411000       2.413400      0.8062000    
 C   0.7588000      -2.482200      0.6325000    
 C    3.048400       2.443100     -0.5683000    
 C    3.162400      -2.298800     -0.7365000    
 C   -2.186100     -6.5800004E-02 -0.3654000    
 C    1.236800       3.631400      0.4926000    
 C    1.411700      -3.645000      0.2343000    
 C    2.442900       3.645900     -0.1960000    
 C    2.615900      -3.552600     -0.4517000    
 C   -2.929900     -0.1667000       1.931000    
 C   -3.512700     -8.3099999E-02 -0.7958000    
 C   -4.256500     -0.1839000       1.500700    
 C   -4.548000     -0.1421000      0.1372000    
 C   -2.970300      0.6158000      -3.128900    
 H  -0.4287000     -0.1239000       2.441400    
 H  -0.2999000       2.438100       1.349700    
 H  -0.1789000      -2.590600       1.171300    
 H    3.993400       2.480900      -1.107200    
 H    4.107300      -2.252900      -1.275200    
 H   -1.377500     -2.9100001E-02  -1.090400    
 H   0.7627000       4.563300      0.7850000    
 H   0.9834000      -4.616900      0.4591000    
 H   -2.718400     -0.1996000       2.997000    
 H    2.916300       4.590900     -0.4455000    
 H    3.133700      -4.453700     -0.7668000    
 H   -5.062500     -0.2298000       2.227200    
 H   -5.586100     -0.1558000     -0.1848000    
 H   -4.780800     -0.1854000      -2.427200    
 H   -2.737900       1.640700      -2.821100    
 H   -3.483600      0.6693000      -4.094400    
 H   -2.037100      6.6799998E-02  -3.289600    


%chk=000053346-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000053346

0 1
N -0.670629 0.549089 1.371530
N 3.146985 0.278217 -0.609331
N -3.877492 -0.855676 -2.099090
C 0.551955 0.436216 0.680946
C 1.423592 1.578564 0.635938
C 0.999761 -0.795085 0.092091
C 2.728735 1.431771 0.002055
C 2.300462 -0.800956 -0.573043
C -1.971756 0.134607 0.964473
C 1.059662 2.866455 1.163928
C 0.273096 -2.033785 0.182857
C 3.627396 2.556215 -0.007726
C 2.759230 -2.017107 -1.193718
C -2.260368 -0.163222 -0.389993
C 1.952303 3.936569 1.129522
C 0.762892 -3.197269 -0.406159
C 3.256579 3.775574 0.551137
C 2.009275 -3.186284 -1.120241
C -2.994376 0.080199 1.948412
C -3.575850 -0.545640 -0.773528
C -4.302866 -0.280229 1.555233
C -4.604210 -0.599564 0.219684
C -2.899678 -0.829908 -3.183573
H -0.658606 1.168318 2.184215
H 0.052756 3.027863 1.566440
H -0.673752 -2.062054 0.727408
H 4.604195 2.404273 -0.477179
H 3.727739 -1.976542 -1.701576
H -1.468336 -0.083089 -1.138116
H 1.653587 4.911948 1.528923
H 0.198094 -4.131732 -0.316779
H -2.764876 0.298277 2.997478
H 3.950152 4.623566 0.536313
H 2.374279 -4.107176 -1.588662
H -5.096925 -0.323999 2.309426
H -5.623234 -0.888490 -0.065126
H -4.843385 -1.086063 -2.321895
H -2.480886 0.185013 -3.344688
H -3.387058 -1.147613 -4.120121
H -2.053137 -1.518950 -2.989067


